1-methyl-N-(3-nitrophenyl)benzotriazole-5-carboxamide

Systemtic Name: 1-methyl-N-(3-nitrophenyl)benzotriazole-5-carboxamide Openeye Name: 1-methyl-N-(3-nitrophenyl)benzotriazole-5-carboxamide CAS Name: 1-methyl-N-(3-nitrophenyl)-5-benzotriazolecarboxamide IUPAC Name: 1-methyl-N-(3-nitrophenyl)benzotriazole-5-carboxamide Traditional Name: 1-methyl-N-(3-nitrophenyl)benzotriazole-5-carboxamide Formula: C14H11N5O3 MolecularWeight: 297.26884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])N=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])N=N1

InChI

InChI=1S/C14H11N5O3/c1-18-13-6-5-9(7-12(13)16-17-18)14(20)15-10-3-2-4-11(8-10)19(21)22/h2-8H,1H3,(H,15,20)